[1-[(2-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(naphthalen-2-ylsulfonylamino)propanoate

Systemtic Name: [1-[(2-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(naphthalen-2-ylsulfonylamino)propanoate Openeye Name: [2-(2-chloroanilino)-1-methyl-2-oxo-ethyl] 3-(2-naphthylsulfonylamino)propanoate CAS Name: 3-(2-naphthalenylsulfonylamino)propanoic acid [1-(2-chloroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-chloroanilino)-1-oxopropan-2-yl] 3-(naphthalen-2-ylsulfonylamino)propanoate Traditional Name: 3-(2-naphthylsulfonylamino)propionic acid [2-(2-chloroanilino)-2-keto-1-methyl-ethyl] ester Formula: C22H21ClN2O5S MolecularWeight: 460.93054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1Cl)OC(=O)CCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1Cl)OC(=O)CCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H21ClN2O5S/c1-15(22(27)25-20-9-5-4-8-19(20)23)30-21(26)12-13-24-31(28,29)18-11-10-16-6-2-3-7-17(16)14-18/h2-11,14-15,24H,12-13H2,1H3,(H,25,27)